CHEBI:211620 - Furfuraceic acid

ChEBI IDCHEBI:211620
ChEBI NameFurfuraceic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC27H32O7
Net Charge0
Average Mass468.546
Monoisotopic Mass468.21480
SMILESCCCCCC(=O)Cc1cc(O)cc2oc3cc(O)c(C(=O)O)c(CC(=O)CCCCC)c3c12
InChIInChI=1S/C27H32O7/c1-3-5-7-9-17(28)11-16-12-19(30)14-22-24(16)26-20(13-18(29)10-8-6-4-2)25(27(32)33)21(31)15-23(26)34-22/h12,14-15,30-31H,3-11,13H2,1-2H3,(H,32,33)
InChIKeyBFEQZBAYSUCJRY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phyllopsora furfuracea (ncbitaxon:2497769) - DOI (10.1071/ch9941619)
ChEBI Ontology
Outgoing Relation(s)
Furfuraceic acid (CHEBI:211620) is a dibenzofurans (CHEBI:38922)
IUPAC Name 
3,7-dihydroxy-1,9-bis(2-oxoheptyl)dibenzouran-2-carboxylic acid
Manual XrefsDatabases
57512713ChemSpider